SCHEMBL11912901

SCHEMBL11912901

COc1ccc(C2c3[nH]c4ccc(Cl)cc4c3CCN2C(=O)C(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.64
MAPT P10636 3/20 0.64
KIF11 P52732 6/20 0.63
SMN1; SMN2 Q16637 2/20 0.62
ABCG2 Q9UNQ0 8/20 0.59
ABCB1 P08183 6/20 0.59
SIRT1 Q96EB6 1/20 0.52
LMNA P02545 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11912869 0.93 KIF11 (0.70) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL22238481 0.92 TP53 (0.64) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL20704585 0.90 TP53 (0.66) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL20704712 0.90 TP53 (0.66) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL904374 0.90 TP53 (0.66) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL765043 0.90 TP53 (0.59) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL8402856 0.90 TP53 (0.61) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL8402676 0.90 TP53 (0.61) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL8402811 0.90 TP53 (0.68) TP53MAPTKIF11SMN1; SMN2ABCG2
SCHEMBL764584 0.89 TP53 (0.67) TP53MAPTKIF11SMN1; SMN2ABCG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC. 2016-11-24 US disclosed
US-9351964-B2 Methods for treating cancer and non-neoplastic conditions PTC THERAPEUTICS, INC. (US) 2016-05-31 US disclosed
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS PTC THERAPEUTICS, INC (US) 2012-08-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160340354-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA TP53 16/4885MAPT 3328/4885KIF11 2569/4885
US-20120202763-A1 METHODS FOR TREATING CANCER AND NON-NEOPLASTIC CONDITIONS HDGF, POLRMT, VEGFA TP53 16/4885MAPT 3328/4885KIF11 2569/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.